Name: Aloveroside A
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT218851535
Cas No:1246930-65-3
常用名:Aloveroside A
IUPAC:1-[4-({[(2R,3R,4R,5R)-3,4-dihydroxy-5-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}methyl)-1-hydroxy-8-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}naphthalen-2-yl]ethan-1-one
IUPAC:1-[4-({[(2R,3R,4R,5R)-3,4-dihydroxy-5-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}methyl)-1-hydroxy-8-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}naphthalen-2-yl]ethan-1-one
InChI key:HCCYPMCFIHZEAY-FHUIRLHESA-N

分子式:C30H40O17
分子量:672.633
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:C[C@@H]1O[C@@H](Oc2cccc3c(CO[C@@H]4OC[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O)cc(C(C)=O)c(O)c23)[C@H](O)[C@H](O)[C@H]1O
SMILES:C[C@@H]1O[C@@H](Oc2cccc3c(CO[C@@H]4OC[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O)cc(C(C)=O)c(O)c23)[C@H](O)[C@H](O)[C@H]1O

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